SCHEMBL17989690

SCHEMBL17989690

CC1(C)c2c(ccc3ccccc23)-c2ccc3c4ccccc4n(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc4)c3c21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AKR1C4 P17516 1/20 0.32
▸ AKR1C3 P42330 1/20 0.32
▸ AKR1C2 P52895 1/20 0.32
▸ AKR1C1 Q04828 1/20 0.32
▸ NTSR1 P30989 1/20 0.32
▸ TUBB4A P04350 2/20 0.31
▸ TUBB P07437 2/20 0.31
▸ TUBA3C P0DPH7 2/20 0.31
▸ TUBA1B P68363 2/20 0.31
▸ TUBA4A P68366 2/20 0.31
▸ TUBB4B P68371 2/20 0.31
▸ TUBB3 Q13509 2/20 0.31
▸ TUBB2A Q13885 2/20 0.31
▸ TUBB8 Q3ZCM7 2/20 0.31
▸ TUBA3E Q6PEY2 2/20 0.31
▸ TUBA1A Q71U36 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17989613 0.94 KDM4E (0.32) KDM4EATML3MBTL1NTSR1TUBB4A
SCHEMBL17988879 0.90 KDM4E (0.44) KDM4EATML3MBTL1TUBB4ATUBB
SCHEMBL17989688 0.87 KDM4E (0.31) HDAC4KDM4EATML3MBTL1CYP1A1
SCHEMBL17989677 0.87 KDM4E (0.31) HDAC4KDM4EATML3MBTL1
SCHEMBL17989681 0.87 KDM4E (0.33) HDAC4KDM4EATML3MBTL1
SCHEMBL19382799 0.86 TUBB4A (0.33) KDM4EATML3MBTL1TUBB4ATUBB
SCHEMBL17988931 0.86 TUBB4A (0.33) KDM4EATML3MBTL1TUBB4ATUBB
SCHEMBL17245701 0.85 KDM4E (0.35) HDAC4KDM4EATML3MBTL1AKR1C4
SCHEMBL17989726 0.85 TUBB4A (0.31) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL17989695 0.84 HDAC4 (0.35) HDAC4KDM4EATML3MBTL1AKR1C4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
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